TL;DR: 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- (CAS 63979-30-6) is a chemical compound with molecular formula C16H22N4O and molecular weight 286.17935 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-1-phenyl-N,N-dipropyltriazole-4-carboxamide
Also Known As: Phenyl-5-methyl-1,2,3-triazole-4-N-dipropylcarboxamide, N,N-Dipropyl-5-methyl-1-phenyl-1,2,3-triazole-4-carboxamide, 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl-, 5-methyl-1-phenyl-n,n-dipropyl-1h-1,2,3-triazole-4-carboxamide, 5-Methyl-N,N-dipropyl-1-phenyl-1H-1,2,3-triazole-4-carboxamide
| Molecular Formula | C16H22N4O |
| Molecular Weight | 286.17935 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.17935 Da |
| Heavy Atoms | 21 |
| Complexity | 324.0 |
| SMILES | CCCN(CCC)C(=O)C1=C(N(N=N1)C2=CC=CC=C2)C |
| InChIKey | OTXYXYOEXXRCPM-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.0 Ų, 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- is 63979-30-6.
The molecular formula of 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- is C16H22N4O.
The molecular weight of 1,2,3-Triazole-4-carboxamide, N,N-dipropyl-5-methyl-1-phenyl- is 286.17935 g/mol.
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